(3β,5β,14β,17β)-14-Hydroxy-17-(3-Thioxo-1,5-Cyclohexadien-1-Yl)Androstan-3-Yl D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C31H46O7S |
| IUPAC Name | 3-[(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-10,13-dimethyl-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]cyclohexa-2,4-diene-1-thione |
| Molecular Mass | 562.758 g·mol−1 |
| Heat of Formation | -1366.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.90 ± 1.08 D |
| Volume | 671.3 Å 3 |
| Surface Area | 501.32 Å 2 |
| HOMO Energy | -8.36 ± 0.55 eV |
| LUMO Energy | -1.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IHIRMPVEMZARQI-OWUASAPFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O |